3-[(2-cyclohexyl-5,6-dimethyl-3H-benzimidazol-1-ium-1-yl)methyl]benzenecarbonitrile

Systemtic Name: 3-[(2-cyclohexyl-5,6-dimethyl-3H-benzimidazol-1-ium-1-yl)methyl]benzenecarbonitrile Openeye Name: 3-[(2-cyclohexyl-5,6-dimethyl-3H-benzimidazol-1-ium-1-yl)methyl]benzonitrile CAS Name: 3-[(2-cyclohexyl-5,6-dimethyl-3H-benzimidazol-1-ium-1-yl)methyl]benzonitrile IUPAC Name: 3-[(2-cyclohexyl-5,6-dimethyl-3H-benzimidazol-1-ium-1-yl)methyl]benzonitrile Traditional Name: 3-[(2-cyclohexyl-5,6-dimethyl-3H-benzimidazol-1-ium-1-yl)methyl]benzonitrile Formula: C23H26N3+ MolecularWeight: 344.47264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)[N+](=C(N2)C3CCCCC3)CC4=CC=CC(=C4)C#N

Isomeric SMILES

CC1=CC2=C(C=C1C)[N+](=C(N2)C3CCCCC3)CC4=CC=CC(=C4)C#N

InChI

InChI=1S/C23H25N3/c1-16-11-21-22(12-17(16)2)26(15-19-8-6-7-18(13-19)14-24)23(25-21)20-9-4-3-5-10-20/h6-8,11-13,20H,3-5,9-10,15H2,1-2H3/p+1